N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-1-methyl-4-nitro-imidazole-2-carboxamide

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-1-methyl-4-nitro-imidazole-2-carboxamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-methyl-4-nitro-imidazole-2-carboxamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-methyl-4-nitro-2-imidazolecarboxamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-methyl-4-nitroimidazole-2-carboxamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-methyl-4-nitro-imidazole-2-carboxamide Formula: C15H29N7O3 MolecularWeight: 355.43586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C(=O)NCCCNCCCCNCCCN)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(N=C1C(=O)NCCCNCCCCNCCCN)[N+](=O)[O-]

InChI

InChI=1S/C15H29N7O3/c1-21-12-13(22(24)25)20-14(21)15(23)19-11-5-10-18-8-3-2-7-17-9-4-6-16/h12,17-18H,2-11,16H2,1H3,(H,19,23)